N-(2-cyanoethyl)-N-[4-[2-cyanoethyl(hexadecanoyl)amino]phenyl]hexadecanamide

Systemtic Name: N-(2-cyanoethyl)-N-[4-[2-cyanoethyl(hexadecanoyl)amino]phenyl]hexadecanamide Openeye Name: N-(2-cyanoethyl)-N-[4-[2-cyanoethyl(hexadecanoyl)amino]phenyl]hexadecanamide CAS Name: N-(2-cyanoethyl)-N-[4-[2-cyanoethyl(1-oxohexadecyl)amino]phenyl]hexadecanamide IUPAC Name: N-(2-cyanoethyl)-N-[4-[2-cyanoethyl(hexadecanoyl)amino]phenyl]hexadecanamide Traditional Name: N-(2-cyanoethyl)-N-[4-[2-cyanoethyl(hexadecanoyl)amino]phenyl]palmitamide Formula: C44H74N4O2 MolecularWeight: 691.08396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)N(CCC#N)C1=CC=C(C=C1)N(CCC#N)C(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N(CCC#N)C1=CC=C(C=C1)N(CCC#N)C(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C44H74N4O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-43(49)47(39-29-37-45)41-33-35-42(36-34-41)48(40-30-38-46)44(50)32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-36H,3-32,39-40H2,1-2H3